ethyl 4-[3-(4-bromophenyl)sulfonylpropanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(4-bromophenyl)sulfonylpropanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(4-bromophenyl)sulfonylpropanoyl]piperazine-1-carboxylate CAS Name: 4-[3-(4-bromophenyl)sulfonyl-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-bromophenyl)sulfonylpropanoyl]piperazine-1-carboxylate Traditional Name: 4-(3-brosylpropanoyl)piperazine-1-carboxylic acid ethyl ester Formula: C16H21BrN2O5S MolecularWeight: 433.31734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CCS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CCS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H21BrN2O5S/c1-2-24-16(21)19-10-8-18(9-11-19)15(20)7-12-25(22,23)14-5-3-13(17)4-6-14/h3-6H,2,7-12H2,1H3